
#######################################################
#                                                     #
#                        LGA                          #
#                  ---------------                    #
#                                                     #
#               Local-Global Alignment                #
#        A Method for Finding 3-D Similarities        #
#               in Protein Structures                 #
#                                                     #
#                  ------------ 10/2009               #
#                                                     #
#      Adam Zemla (adamz@llnl.gov)                    #
#      Lawrence Livermore National Laboratory, CA     #
#                                                     #
#######################################################

!!!   License for LGA program has expired  !!!
#   For updated version of the LGA program   #
# please contact Adam Zemla:  adamz@llnl.gov #

# Molecule1: number of CA atoms  256 ( 1915),  selected  240 , name one
# Molecule2: number of CA atoms  240 ( 1805),  selected  240 , name two
# PARAMETERS: input.pdb  -ie  -3  -d:4  -sda  -swap  -ch1:A  -ch2:A  
# FIXED Atom-Atom correspondence
# GDT and LCS analysis 

LCS - RMSD CUTOFF   5.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   131       4_A - 134_A       4.96    28.00
  LCS_AVERAGE:     52.88

LCS - RMSD CUTOFF   2.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   126       4_A - 129_A       1.71    29.69
  LCS_AVERAGE:     50.32

LCS - RMSD CUTOFF   1.00      length       segment         l_RMS    g_RMS
  LONGEST_CONTINUOUS_SEGMENT:   102       4_A - 105_A       1.00    29.59
  LCS_AVERAGE:     27.70

LCS_GDT    MOLECULE-1    MOLECULE-2     LCS_DETAILS     GDT_DETAILS                                                    TOTAL NUMBER OF RESIDUE PAIRS:  240
LCS_GDT     RESIDUE       RESIDUE       SEGMENT_SIZE    GLOBAL DISTANCE TEST COLUMNS: number of residues under the threshold assigned to each residue pair
LCS_GDT   NAME NUMBER   NAME NUMBER    1.0  2.0  5.0    0.5  1.0  1.5  2.0  2.5  3.0  3.5  4.0  4.5  5.0  5.5  6.0  6.5  7.0  7.5  8.0  8.5  9.0  9.5 10.0
LCS_GDT     E     4_A     E     4_A    102  126  131      5   21   53  103  115  118  119  120  122  123  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     V     5_A     V     5_A    102  126  131      9   62   99  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q     6_A     Q     6_A    102  126  131     33   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     L     7_A     L     7_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     V     8_A     V     8_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q     9_A     Q     9_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S    10_A     S    10_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    11_A     G    11_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    12_A     A    12_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     E    13_A     E    13_A    102  126  131     51   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     V    14_A     V    14_A    102  126  131     37   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     K    15_A     K    15_A    102  126  131     25   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     K    16_A     K    16_A    102  126  131     25   88  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     P    17_A     P    17_A    102  126  131     30   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     G    18_A     G    18_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     S    19_A     S    19_A    102  126  131     43   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     S    20_A     S    20_A    102  126  131     28   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     V    21_A     V    21_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     K    22_A     K    22_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     V    23_A     V    23_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S    24_A     S    24_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     C    25_A     C    25_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     K    26_A     K    26_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    27_A     A    27_A    102  126  131     39   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S    28_A     S    28_A    102  126  131     14   58  103  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    29_A     G    29_A    102  126  131     11   39  100  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    30_A     G    30_A    102  126  131     41   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    31_A     T    31_A    102  126  131     50   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F    32_A     F    32_A    102  126  131      3   87  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     N    33_A     N    33_A    102  126  131      3   46  104  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     R    34_A     R    34_A    102  126  131      3   65  103  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y    35_A     Y    35_A    102  126  131     48   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    36_A     T    36_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     V    37_A     V    37_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     N    38_A     N    38_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     W    39_A     W    39_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     V    40_A     V    40_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     R    41_A     R    41_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q    42_A     Q    42_A    102  126  131     46   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    43_A     A    43_A    102  126  131     20   87  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  128  130  132 
LCS_GDT     P    44_A     P    44_A    102  126  131     20   87  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     G    45_A     G    45_A    102  126  131     46   91  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q    46_A     Q    46_A    102  126  131     37   91  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    47_A     G    47_A    102  126  131     29   87  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     L    48_A     L    48_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     E    49_A     E    49_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     W    50_A     W    50_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     M    51_A     M    51_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    52_A     G    52_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    53_A     G    53_A    102  126  131     22   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     I    54_A     I    54_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     I    55_A     I    55_A    102  126  131     38   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     P    56_A     P    56_A    102  126  131     50   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     I    57_A     I    57_A    102  126  131     33   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F    58_A     F    58_A    102  126  131     26   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    59_A     G    59_A    102  126  131      3   84  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    60_A     T    60_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    61_A     A    61_A    102  126  131     51   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     N    62_A     N    62_A    102  126  131     47   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y    63_A     Y    63_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    64_A     A    64_A    102  126  131     52   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q    65_A     Q    65_A    102  126  131     55   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     R    66_A     R    66_A    102  126  131      9   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F    67_A     F    67_A    102  126  131      9   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q    68_A     Q    68_A    102  126  131      9   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G    69_A     G    69_A    102  126  131      9   82  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     R    70_A     R    70_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     L    71_A     L    71_A    102  126  131     47   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    72_A     T    72_A    102  126  131     47   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     I    73_A     I    73_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    74_A     T    74_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    75_A     A    75_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     D    76_A     D    76_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     E    77_A     E    77_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S    78_A     S    78_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    79_A     T    79_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S    80_A     S    80_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T    81_A     T    81_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A    82_A     A    82_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y    83_A     Y    83_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     M    84_A     M    84_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     E    85_A     E    85_A    102  126  131     37   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     L    86_A     L    86_A    102  126  131     33   91  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     S    87_A     S    87_A    102  126  131     37   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     S    88_A     S    88_A    102  126  131     47   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     L    89_A     L    89_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     R    90_A     R    90_A    102  126  131     21   80  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     S    91_A     S    91_A    102  126  131      4   21   83  110  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     D    92_A     D    92_A    102  126  131      3   50  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     D    93_A     D    93_A    102  126  131     47   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     T    94_A     T    94_A    102  126  131     13   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     A    95_A     A    95_A    102  126  131     13   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     V    96_A     V    96_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     Y    97_A     Y    97_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F    98_A     F    98_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     C    99_A     C    99_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     A   100_A     A   100_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     R   101_A     R   101_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     E   102_A     E   102_A    102  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     N   103_A     N   103_A    102  126  131     47   91  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     L   104_A     L   104_A    102  126  131     15   76  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     D   105_A     D   105_A    102  126  131      3    5   66  102  112  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     N   106_A     N   106_A      3  126  131      3    3    3   10   25  111  116  120  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S   107_A     S   107_A      3  126  131      3    3   15   20   91  113  119  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G   108_A     G   108_A      4  126  131      4    4    4    4    6    8    9   56  118  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T   109_A     T   109_A      4  126  131      4    4    4    4    8   21   44  109  118  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y   110_A     Y   110_A      4  126  131      4    4    4   15   47   73  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y   111_A     Y   111_A      4  126  131      4    4   49  106  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Y   112_A     Y   112_A      3  126  131      3    3    4   10   48  109  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F   113_A     F   113_A     15  126  131      0    3   88  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     S   114_A     S   114_A     15  126  131     13   62   97  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G   115_A     G   115_A     15  126  131      3   59   99  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     W   116_A     W   116_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     F   117_A     F   117_A     15  126  131     33   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     D   118_A     D   118_A     15  126  131     28   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     P   119_A     P   119_A     15  126  131     52   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     W   120_A     W   120_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G   121_A     G   121_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     Q   122_A     Q   122_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     G   123_A     G   123_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  128 
LCS_GDT     T   124_A     T   124_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  127  128  129 
LCS_GDT     L   125_A     L   125_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     V   126_A     V   126_A     15  126  131     56   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     T   127_A     T   127_A     15  126  131     42   92  105  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     V   128_A     V   128_A     15  126  131     16   60  104  115  116  118  120  121  122  124  125  126  126  126  126  127  127  129  131  132 
LCS_GDT     S   129_A     S   129_A      4  126  131      3    3   11   23   58   83  110  116  120  123  124  126  126  126  126  127  127  129  131  132 
LCS_GDT     S   130_A     S   130_A      4  115  131      3    4    5   14   34   52   81  107  112  114  114  117  119  124  126  127  127  129  131  132 
LCS_GDT     Q   131_A     Q   131_A      4  115  131      3    4    4    5   17   33   64   82  111  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   132_A     S   132_A     23  115  131      0    4   17   82   96  104  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   133_A     A   133_A     24  115  131      3    4   49   75   96  104  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   134_A     L   134_A     24  115  131     15   76   93   97  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   135_A     T   135_A     24  115  122     37   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Q   136_A     Q   136_A     24  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   137_A     P   137_A     24  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     R   138_A     R   138_A     24  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   139_A     S   139_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   140_A     V   140_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   141_A     S   141_A     24  115  122     31   78   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   142_A     G   142_A     24  115  122     20   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   143_A     S   143_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   144_A     P   144_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   145_A     G   145_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Q   146_A     Q   146_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   147_A     S   147_A     24  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   148_A     V   148_A     24  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   149_A     T   149_A     24  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     I   150_A     I   150_A     24  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   151_A     S   151_A     24  115  122     36   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     C   152_A     C   152_A     24  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   153_A     T   153_A     24  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   154_A     G   154_A     24  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   155_A     T   155_A     24  115  122      3   38   82   97  101  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   156_A     S   156_A     24  115  122      3   12   30   84   95  104  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   157_A     S   157_A      6  115  122      3   11   60   78  101  104  108  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   158_A     D   158_A     66  115  122      5   25   86   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     I   159_A     I   159_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   160_A     G   160_A     66  115  122      7   40   82   98  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   161_A     G   161_A     66  115  122     32   78   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   162_A     Y   162_A     66  115  122      3    3   74   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     N   163_A     N   163_A     66  115  122      3   24   48   88   99  104  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     F   164_A     F   164_A     66  115  122     31   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   165_A     V   165_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   166_A     S   166_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     W   167_A     W   167_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   168_A     Y   168_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Q   169_A     Q   169_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Q   170_A     Q   170_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     H   171_A     H   171_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   172_A     P   172_A     66  115  122     45   84   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   173_A     G   173_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     K   174_A     K   174_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   175_A     A   175_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   176_A     P   176_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     K   177_A     K   177_A     66  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   178_A     L   178_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     M   179_A     M   179_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     I   180_A     I   180_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   181_A     Y   181_A     66  115  122     43   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   182_A     D   182_A     66  115  122      3   13   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   183_A     A   183_A     66  115  122      8   60   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   184_A     T   184_A     66  115  122     22   79   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     K   185_A     K   185_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     R   186_A     R   186_A     66  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   187_A     P   187_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   188_A     S   188_A     66  115  122     37   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   189_A     G   189_A     66  115  122     15   81   93   98  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   190_A     V   190_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   191_A     P   191_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   192_A     D   192_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     R   193_A     R   193_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     F   194_A     F   194_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   195_A     S   195_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   196_A     G   196_A     66  115  122     29   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   197_A     S   197_A     66  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     K   198_A     K   198_A     66  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   199_A     S   199_A     66  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   200_A     G   200_A     66  115  122     46   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     N   201_A     N   201_A     66  115  122     46   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   202_A     T   202_A     66  115  122     48   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   203_A     A   203_A     66  115  122     50   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   204_A     S   204_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   205_A     L   205_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   206_A     T   206_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     I   207_A     I   207_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   208_A     S   208_A     66  115  122     28   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   209_A     G   209_A     66  115  122     24   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   210_A     L   210_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Q   211_A     Q   211_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   212_A     A   212_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     E   213_A     E   213_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   214_A     D   214_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     E   215_A     E   215_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   216_A     A   216_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   217_A     D   217_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   218_A     Y   218_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   219_A     Y   219_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     C   220_A     C   220_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     C   221_A     C   221_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     S   222_A     S   222_A     66  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   223_A     Y   223_A     66  115  122     24   77   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     A   224_A     A   224_A     63  115  122      3    6   30   84  102  104  106  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   225_A     G   225_A      6  115  122      0    6    9   50   87  104  106  107  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     D   226_A     D   226_A      3  115  122      3   33   80   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     Y   227_A     Y   227_A      3  115  122      8   49   82   97  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   228_A     T   228_A     15  115  122     11   66   91   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     P   229_A     P   229_A     15  115  122     15   72   92   98  103  105  109  111  112  114  114  117  119  121  123  125  125  129  131  132 
LCS_GDT     G   230_A     G   230_A     15  115  122     10   41   90   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   231_A     V   231_A     15  115  122     40   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   232_A     V   232_A     15  115  122     40   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     F   233_A     F   233_A     15  115  122     40   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   234_A     G   234_A     15  115  122     38   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   235_A     G   235_A     15  115  122     47   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   236_A     G   236_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   237_A     T   237_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     K   238_A     K   238_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   239_A     L   239_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     T   240_A     T   240_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     V   241_A     V   241_A     15  115  122     53   85   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     L   242_A     L   242_A     15  115  122     11   76   93   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_GDT     G   243_A     G   243_A     15  115  122      4   24   89   99  103  105  109  111  112  114  114  117  119  121  123  125  126  129  131  132 
LCS_AVERAGE  LCS_A:  43.64  (  27.70   50.32   52.88 )

GLOBAL_DISTANCE_TEST (summary information about detected largest sets of residues (represented by selected AToms) that can fit under specified thresholds)
GDT DIST_CUTOFF  0.50   1.00   1.50   2.00   2.50   3.00   3.50   4.00   4.50   5.00   5.50   6.00   6.50   7.00   7.50   8.00   8.50   9.00   9.50  10.00
GDT NUMBER_AT     56     92    105    115    116    118    120    121    122    124    125    126    126    126    126    127    127    129    131    132 
GDT PERCENT_AT  23.33  38.33  43.75  47.92  48.33  49.17  50.00  50.42  50.83  51.67  52.08  52.50  52.50  52.50  52.50  52.92  52.92  53.75  54.58  55.00
GDT RMS_LOCAL    0.33   0.58   0.70   0.88   0.91   0.99   1.14   1.23   1.27   1.56   1.60   1.71   1.71   1.71   1.71   2.05   2.05   4.22   4.45   4.50
GDT RMS_ALL_AT  29.68  29.51  29.63  29.55  29.52  29.52  29.60  29.63  29.61  29.82  29.80  29.69  29.69  29.69  29.69  29.50  29.50  28.55  28.24  28.25

# Checking swapping
#   possible swapping detected:  E     4_A      E     4_A
#   possible swapping detected:  E    13_A      E    13_A
#   possible swapping detected:  Y    35_A      Y    35_A
#   possible swapping detected:  F    58_A      F    58_A
#   possible swapping detected:  Y    63_A      Y    63_A
#   possible swapping detected:  F    67_A      F    67_A
#   possible swapping detected:  E    77_A      E    77_A
#   possible swapping detected:  F    98_A      F    98_A
#   possible swapping detected:  E   102_A      E   102_A
#   possible swapping detected:  D   105_A      D   105_A
#   possible swapping detected:  Y   110_A      Y   110_A
#   possible swapping detected:  F   117_A      F   117_A
#   possible swapping detected:  D   158_A      D   158_A
#   possible swapping detected:  Y   162_A      Y   162_A
#   possible swapping detected:  F   164_A      F   164_A
#   possible swapping detected:  Y   168_A      Y   168_A
#   possible swapping detected:  Y   181_A      Y   181_A
#   possible swapping detected:  D   182_A      D   182_A
#   possible swapping detected:  D   192_A      D   192_A
#   possible swapping detected:  D   214_A      D   214_A
#   possible swapping detected:  D   217_A      D   217_A
#   possible swapping detected:  Y   218_A      Y   218_A
#   possible swapping detected:  Y   223_A      Y   223_A
#   possible swapping detected:  D   226_A      D   226_A
#   possible swapping detected:  F   233_A      F   233_A

#      Molecule1      Molecule2  DISTANCE    Mis    MC     All    Dist_max   GDC_mc  GDC_all
LGA    E     4_A      E     4_A     3.725     0    0.257   0.940     5.734   39.524   54.497
LGA    V     5_A      V     5_A     2.149     0    0.063   0.073     2.624   66.905   66.054
LGA    Q     6_A      Q     6_A     1.231     0    0.007   0.874     3.083   79.286   71.481
LGA    L     7_A      L     7_A     0.588     0    0.088   0.115     0.784   90.476   91.667
LGA    V     8_A      V     8_A     0.530     0    0.022   0.068     0.672   95.238   93.197
LGA    Q     9_A      Q     9_A     0.188     0    0.052   0.144     0.750  100.000   98.942
LGA    S    10_A      S    10_A     0.163     0    0.044   0.066     0.243  100.000  100.000
LGA    G    11_A      G    11_A     0.224     0    0.023   0.023     0.224  100.000  100.000
LGA    A    12_A      A    12_A     0.212     0    0.060   0.074     0.272  100.000  100.000
LGA    E    13_A      E    13_A     0.393     0    0.019   0.378     2.512  100.000   88.148
LGA    V    14_A      V    14_A     0.904     0    0.070   0.159     1.645   85.952   84.082
LGA    K    15_A      K    15_A     1.187     0    0.047   0.455     1.707   81.429   82.487
LGA    K    16_A      K    16_A     1.369     0    0.033   0.320     2.615   83.690   74.127
LGA    P    17_A      P    17_A     1.033     0    0.026   0.063     1.669   85.952   81.565
LGA    G    18_A      G    18_A     0.236     0    0.070   0.070     0.503   97.619   97.619
LGA    S    19_A      S    19_A     0.836     0    0.023   0.126     1.143   92.857   90.556
LGA    S    20_A      S    20_A     0.835     0    0.037   0.189     1.436   90.476   87.460
LGA    V    21_A      V    21_A     0.528     0    0.037   0.067     0.602   95.238   94.558
LGA    K    22_A      K    22_A     0.366     0    0.073   0.518     3.428   97.619   81.693
LGA    V    23_A      V    23_A     0.387     0    0.060   0.127     1.124  100.000   94.626
LGA    S    24_A      S    24_A     0.308     0    0.059   0.078     0.514  100.000   98.413
LGA    C    25_A      C    25_A     0.243     0    0.048   0.057     0.382  100.000  100.000
LGA    K    26_A      K    26_A     0.422     0    0.017   0.437     2.249   95.238   88.836
LGA    A    27_A      A    27_A     0.888     0    0.037   0.045     1.146   85.952   85.048
LGA    S    28_A      S    28_A     1.980     0    0.610   0.574     4.394   64.048   68.413
LGA    G    29_A      G    29_A     1.820     0    0.612   0.612     4.260   64.048   64.048
LGA    G    30_A      G    30_A     0.740     0    0.150   0.150     1.022   88.214   88.214
LGA    T    31_A      T    31_A     0.464     0    0.663   1.326     2.964   84.524   80.884
LGA    F    32_A      F    32_A     1.200     0    0.115   0.410     1.518   83.690   82.338
LGA    N    33_A      N    33_A     1.647     0    0.104   1.040     3.695   72.976   68.214
LGA    R    34_A      R    34_A     1.810     0    0.075   0.803     3.674   72.976   66.580
LGA    Y    35_A      Y    35_A     0.742     0    0.069   0.109     2.672   90.476   78.968
LGA    T    36_A      T    36_A     0.496     0    0.091   1.187     3.071   97.619   85.102
LGA    V    37_A      V    37_A     0.174     0    0.013   0.105     0.651  100.000   98.639
LGA    N    38_A      N    38_A     0.156     0    0.038   0.285     1.104  100.000   97.679
LGA    W    39_A      W    39_A     0.320     0    0.025   0.042     0.398  100.000  100.000
LGA    V    40_A      V    40_A     0.325     0    0.022   0.046     0.411  100.000  100.000
LGA    R    41_A      R    41_A     0.259     0    0.057   1.265     4.583  100.000   80.476
LGA    Q    42_A      Q    42_A     0.862     0    0.049   0.213     1.219   85.952   85.450
LGA    A    43_A      A    43_A     1.297     0    0.035   0.034     1.435   81.429   81.429
LGA    P    44_A      P    44_A     1.479     0    0.061   0.068     2.171   79.286   74.218
LGA    G    45_A      G    45_A     0.957     0    0.092   0.092     1.016   88.214   88.214
LGA    Q    46_A      Q    46_A     1.011     0    0.019   1.259     4.792   83.690   70.476
LGA    G    47_A      G    47_A     1.342     0    0.049   0.049     1.342   85.952   85.952
LGA    L    48_A      L    48_A     0.592     0    0.023   0.151     0.819   90.476   94.048
LGA    E    49_A      E    49_A     0.308     0    0.052   0.270     1.353  100.000   94.762
LGA    W    50_A      W    50_A     0.270     0    0.011   0.173     0.638  100.000   96.599
LGA    M    51_A      M    51_A     0.420     0    0.057   0.113     0.566   97.619   98.810
LGA    G    52_A      G    52_A     0.166     0    0.052   0.052     0.228  100.000  100.000
LGA    G    53_A      G    53_A     0.681     0    0.067   0.067     0.681   95.238   95.238
LGA    I    54_A      I    54_A     0.293     0    0.055   0.134     0.516   97.619   98.810
LGA    I    55_A      I    55_A     0.693     0    0.109   0.197     1.534   90.476   86.012
LGA    P    56_A      P    56_A     0.567     0    0.052   0.062     0.719   92.857   91.837
LGA    I    57_A      I    57_A     0.790     0    0.140   1.377     3.847   88.214   76.190
LGA    F    58_A      F    58_A     0.904     0    0.085   0.512     2.866   90.476   78.701
LGA    G    59_A      G    59_A     1.394     0    0.542   0.542     4.035   70.476   70.476
LGA    T    60_A      T    60_A     0.457     0    0.211   1.071     3.199   93.214   82.585
LGA    A    61_A      A    61_A     0.687     0    0.062   0.094     1.881   86.071   85.143
LGA    N    62_A      N    62_A     0.757     0    0.079   0.848     3.502   95.238   76.607
LGA    Y    63_A      Y    63_A     0.370     0    0.029   0.390     1.135  100.000   95.317
LGA    A    64_A      A    64_A     0.589     0    0.069   0.082     0.662   92.857   92.381
LGA    Q    65_A      Q    65_A     0.573     0    0.041   0.558     2.921   92.857   81.111
LGA    R    66_A      R    66_A     0.846     0    0.073   1.515     6.722   90.476   66.753
LGA    F    67_A      F    67_A     0.691     0    0.033   0.103     0.775   90.476   90.476
LGA    Q    68_A      Q    68_A     0.715     0    0.649   0.707     3.019   80.357   84.974
LGA    G    69_A      G    69_A     1.375     0    0.090   0.090     1.476   81.429   81.429
LGA    R    70_A      R    70_A     0.319     0    0.079   1.275     4.168   95.238   83.377
LGA    L    71_A      L    71_A     0.725     0    0.069   0.917     3.323   92.857   79.048
LGA    T    72_A      T    72_A     0.681     0    0.061   1.063     2.443   90.476   83.129
LGA    I    73_A      I    73_A     0.412     0    0.016   0.131     0.536  100.000   96.429
LGA    T    74_A      T    74_A     0.375     0    0.008   0.267     0.751  100.000   97.279
LGA    A    75_A      A    75_A     0.481     0    0.041   0.059     0.704   95.238   96.190
LGA    D    76_A      D    76_A     0.412     0    0.049   0.431     1.518  100.000   95.417
LGA    E    77_A      E    77_A     0.231     0    0.073   1.309     5.376  100.000   75.185
LGA    S    78_A      S    78_A     0.286     0    0.169   0.185     1.040   95.357   93.730
LGA    T    79_A      T    79_A     0.489     0    0.076   0.982     2.795   97.619   86.122
LGA    S    80_A      S    80_A     0.122     0    0.029   0.203     1.294  100.000   96.905
LGA    T    81_A      T    81_A     0.424     0    0.061   0.105     0.526  100.000   98.639
LGA    A    82_A      A    82_A     0.330     0    0.008   0.010     0.352  100.000  100.000
LGA    Y    83_A      Y    83_A     0.253     0    0.043   0.111     0.588   97.619   99.206
LGA    M    84_A      M    84_A     0.464     0    0.019   0.578     2.288  100.000   89.821
LGA    E    85_A      E    85_A     0.679     0    0.018   0.516     1.993   90.476   86.508
LGA    L    86_A      L    86_A     0.949     0    0.022   1.106     4.944   85.952   72.321
LGA    S    87_A      S    87_A     0.859     0    0.043   0.692     1.615   90.476   87.540
LGA    S    88_A      S    88_A     0.734     0    0.027   0.788     3.355   90.476   83.730
LGA    L    89_A      L    89_A     0.411     0    0.015   0.092     0.628   95.238   97.619
LGA    R    90_A      R    90_A     1.425     0    0.025   1.208     5.653   81.548   59.481
LGA    S    91_A      S    91_A     2.675     0    0.729   0.671     5.042   49.524   48.571
LGA    D    92_A      D    92_A     1.825     0    0.025   0.926     2.133   72.857   72.917
LGA    D    93_A      D    93_A     0.839     0    0.079   0.158     1.109   88.214   89.345
LGA    T    94_A      T    94_A     1.172     0    0.343   0.919     3.267   73.214   67.551
LGA    A    95_A      A    95_A     1.017     0    0.028   0.057     1.293   83.690   83.238
LGA    V    96_A      V    96_A     0.686     0    0.038   0.082     0.866   90.476   90.476
LGA    Y    97_A      Y    97_A     0.453     0    0.059   0.374     1.448   97.619   93.730
LGA    F    98_A      F    98_A     0.444     0    0.028   0.128     0.665  100.000   96.537
LGA    C    99_A      C    99_A     0.297     0    0.050   0.070     0.436  100.000  100.000
LGA    A   100_A      A   100_A     0.319     0    0.024   0.025     0.347  100.000  100.000
LGA    R   101_A      R   101_A     0.332     0    0.050   0.864     3.703  100.000   90.563
LGA    E   102_A      E   102_A     0.368     0    0.067   1.118     2.793   92.976   82.063
LGA    N   103_A      N   103_A     0.770     0    0.664   1.087     3.102   80.476   79.940
LGA    L   104_A      L   104_A     1.522     0    0.359   0.828     3.289   75.000   71.131
LGA    D   105_A      D   105_A     3.626     0    0.160   0.862     7.353   46.786   37.440
LGA    N   106_A      N   106_A     6.224     0    0.266   1.307    10.770   23.929   13.571
LGA    S   107_A      S   107_A     5.056     0    0.019   0.200     6.509   27.500   24.127
LGA    G   108_A      G   108_A     6.508     0    0.247   0.247     6.508   20.595   20.595
LGA    T   109_A      T   109_A     6.858     0    0.176   1.142     9.270   15.357   10.680
LGA    Y   110_A      Y   110_A     4.380     0    0.666   1.287    13.277   31.786   16.508
LGA    Y   111_A      Y   111_A     2.944     0    0.183   0.396     9.867   55.357   30.357
LGA    Y   112_A      Y   112_A     4.112     0    0.624   1.242    16.056   50.595   18.571
LGA    F   113_A      F   113_A     2.073     0    0.680   1.009     7.989   79.524   43.766
LGA    S   114_A      S   114_A     2.320     0    0.624   0.573     4.995   54.524   56.667
LGA    G   115_A      G   115_A     1.813     0    0.269   0.269     1.813   81.548   81.548
LGA    W   116_A      W   116_A     0.162     0    0.639   1.175     5.683   80.476   62.381
LGA    F   117_A      F   117_A     0.899     0    0.266   0.578     2.837   88.214   77.836
LGA    D   118_A      D   118_A     1.236     0    0.278   0.879     5.690   69.762   53.571
LGA    P   119_A      P   119_A     0.453     0    0.205   0.424     2.257   92.976   84.558
LGA    W   120_A      W   120_A     0.422     0    0.012   0.092     0.726   97.619   93.878
LGA    G   121_A      G   121_A     0.386     0    0.050   0.050     0.437  100.000  100.000
LGA    Q   122_A      Q   122_A     0.664     0    0.045   0.983     3.136   90.476   82.011
LGA    G   123_A      G   123_A     0.532     0    0.044   0.044     0.558   92.857   92.857
LGA    T   124_A      T   124_A     0.695     0    0.052   0.086     0.769   90.476   90.476
LGA    L   125_A      L   125_A     0.577     0    0.078   0.208     0.657   95.238   92.857
LGA    V   126_A      V   126_A     0.437     0    0.017   0.038     0.700   92.857   94.558
LGA    T   127_A      T   127_A     0.844     0    0.066   0.201     1.361   88.333   89.252
LGA    V   128_A      V   128_A     2.118     0    0.507   0.641     3.115   63.095   68.639
LGA    S   129_A      S   129_A     6.957     0    0.106   0.675    10.715    8.810    9.762
LGA    S   130_A      S   130_A    13.095     0    0.508   0.707    15.151    0.000    0.000
LGA    Q   131_A      Q   131_A    19.676     0    0.143   0.424    25.395    0.000    0.000
LGA    S   132_A      S   132_A    23.413     0    0.065   0.776    26.065    0.000    0.000
LGA    A   133_A      A   133_A    29.598     0    0.627   0.603    32.988    0.000    0.000
LGA    L   134_A      L   134_A    34.642     0    0.042   0.196    38.868    0.000    0.000
LGA    T   135_A      T   135_A    35.191     0    0.048   0.056    38.411    0.000    0.000
LGA    Q   136_A      Q   136_A    35.093     0    0.033   0.203    35.093    0.000    0.000
LGA    P   137_A      P   137_A    35.253     0    0.039   0.299    38.361    0.000    0.000
LGA    R   138_A      R   138_A    28.940     0    0.092   0.869    31.514    0.000    0.000
LGA    S   139_A      S   139_A    30.257     0    0.076   0.540    34.841    0.000    0.000
LGA    V   140_A      V   140_A    35.206     0    0.039   0.114    37.815    0.000    0.000
LGA    S   141_A      S   141_A    35.698     0    0.085   0.697    40.115    0.000    0.000
LGA    G   142_A      G   142_A    38.848     0    0.017   0.017    38.848    0.000    0.000
LGA    S   143_A      S   143_A    38.611     0    0.020   0.041    40.538    0.000    0.000
LGA    P   144_A      P   144_A    37.352     0    0.049   0.287    41.430    0.000    0.000
LGA    G   145_A      G   145_A    43.925     0    0.070   0.070    47.880    0.000    0.000
LGA    Q   146_A      Q   146_A    46.674     0    0.050   0.890    49.056    0.000    0.000
LGA    S   147_A      S   147_A    48.228     0    0.011   0.073    51.949    0.000    0.000
LGA    V   148_A      V   148_A    44.675     0    0.082   1.152    45.750    0.000    0.000
LGA    T   149_A      T   149_A    46.470     0    0.031   0.074    51.026    0.000    0.000
LGA    I   150_A      I   150_A    41.780     0    0.048   0.057    44.140    0.000    0.000
LGA    S   151_A      S   151_A    44.608     0    0.026   0.751    47.141    0.000    0.000
LGA    C   152_A      C   152_A    42.275     0    0.050   0.062    46.055    0.000    0.000
LGA    T   153_A      T   153_A    44.620     0    0.042   0.096    47.012    0.000    0.000
LGA    G   154_A      G   154_A    44.268     0    0.066   0.066    46.160    0.000    0.000
LGA    T   155_A      T   155_A    46.098     0    0.683   0.680    47.928    0.000    0.000
LGA    S   156_A      S   156_A    51.311     0    0.264   0.635    53.693    0.000    0.000
LGA    S   157_A      S   157_A    52.725     0    0.170   0.689    52.898    0.000    0.000
LGA    D   158_A      D   158_A    50.145     0    0.358   1.123    52.755    0.000    0.000
LGA    I   159_A      I   159_A    52.526     0    0.231   0.428    57.151    0.000    0.000
LGA    G   160_A      G   160_A    59.243     0    0.034   0.034    63.102    0.000    0.000
LGA    G   161_A      G   161_A    60.389     0    0.307   0.307    61.288    0.000    0.000
LGA    Y   162_A      Y   162_A    61.649     0    0.597   1.226    64.748    0.000    0.000
LGA    N   163_A      N   163_A    58.745     0    0.693   1.215    60.252    0.000    0.000
LGA    F   164_A      F   164_A    54.897     0    0.313   0.357    62.552    0.000    0.000
LGA    V   165_A      V   165_A    49.936     0    0.119   0.124    52.297    0.000    0.000
LGA    S   166_A      S   166_A    45.896     0    0.020   0.670    46.786    0.000    0.000
LGA    W   167_A      W   167_A    40.573     0    0.029   0.067    45.568    0.000    0.000
LGA    Y   168_A      Y   168_A    34.834     0    0.075   1.257    41.916    0.000    0.000
LGA    Q   169_A      Q   169_A    30.041     0    0.020   0.363    32.082    0.000    0.000
LGA    Q   170_A      Q   170_A    23.459     0    0.031   0.101    25.494    0.000    0.000
LGA    H   171_A      H   171_A    18.770     0    0.057   0.189    24.903    0.000    0.000
LGA    P   172_A      P   172_A    12.229     0    0.023   0.026    14.171    0.000    0.068
LGA    G   173_A      G   173_A    15.028     0    0.073   0.073    19.323    0.000    0.000
LGA    K   174_A      K   174_A    21.344     0    0.042   0.748    22.952    0.000    0.000
LGA    A   175_A      A   175_A    26.186     0    0.037   0.037    28.755    0.000    0.000
LGA    P   176_A      P   176_A    28.506     0    0.013   0.325    32.443    0.000    0.000
LGA    K   177_A      K   177_A    34.538     0    0.077   0.776    36.221    0.000    0.000
LGA    L   178_A      L   178_A    40.556     0    0.019   0.038    47.441    0.000    0.000
LGA    M   179_A      M   179_A    42.406     0    0.051   0.213    46.801    0.000    0.000
LGA    I   180_A      I   180_A    48.142     0    0.059   0.632    51.190    0.000    0.000
LGA    Y   181_A      Y   181_A    52.049     0    0.113   0.948    58.910    0.000    0.000
LGA    D   182_A      D   182_A    56.232     0    0.150   1.055    61.400    0.000    0.000
LGA    A   183_A      A   183_A    55.717     0    0.176   0.184    58.037    0.000    0.000
LGA    T   184_A      T   184_A    59.210     0    0.035   0.060    63.638    0.000    0.000
LGA    K   185_A      K   185_A    59.104     0    0.310   0.373    67.283    0.000    0.000
LGA    R   186_A      R   186_A    54.132     0    0.061   0.764    59.117    0.000    0.000
LGA    P   187_A      P   187_A    53.267     0    0.056   0.298    53.340    0.000    0.000
LGA    S   188_A      S   188_A    54.806     0    0.668   0.834    56.894    0.000    0.000
LGA    G   189_A      G   189_A    48.697     0    0.024   0.024    51.118    0.000    0.000
LGA    V   190_A      V   190_A    46.447     0    0.036   0.048    50.105    0.000    0.000
LGA    P   191_A      P   191_A    47.439     0    0.042   0.086    49.194    0.000    0.000
LGA    D   192_A      D   192_A    53.239     0    0.080   1.193    56.939    0.000    0.000
LGA    R   193_A      R   193_A    49.155     0    0.055   1.239    50.009    0.000    0.000
LGA    F   194_A      F   194_A    47.690     0    0.076   0.095    51.634    0.000    0.000
LGA    S   195_A      S   195_A    53.039     0    0.080   0.103    55.301    0.000    0.000
LGA    G   196_A      G   196_A    53.597     0    0.100   0.100    58.206    0.000    0.000
LGA    S   197_A      S   197_A    58.104     0    0.052   0.080    59.713    0.000    0.000
LGA    K   198_A      K   198_A    58.599     0    0.027   0.729    63.016    0.000    0.000
LGA    S   199_A      S   199_A    62.069     0    0.029   0.077    65.089    0.000    0.000
LGA    G   200_A      G   200_A    61.257     0    0.036   0.036    62.231    0.000    0.000
LGA    N   201_A      N   201_A    54.079     0    0.020   1.029    56.755    0.000    0.000
LGA    T   202_A      T   202_A    52.182     0    0.053   0.130    54.857    0.000    0.000
LGA    A   203_A      A   203_A    50.707     0    0.029   0.047    50.707    0.000    0.000
LGA    S   204_A      S   204_A    49.654     0    0.041   0.097    51.897    0.000    0.000
LGA    L   205_A      L   205_A    46.375     0    0.010   0.145    47.102    0.000    0.000
LGA    T   206_A      T   206_A    48.394     0    0.030   0.036    52.187    0.000    0.000
LGA    I   207_A      I   207_A    44.839     0    0.030   0.106    46.094    0.000    0.000
LGA    S   208_A      S   208_A    49.034     0    0.555   0.989    53.400    0.000    0.000
LGA    G   209_A      G   209_A    45.691     0    0.093   0.093    47.255    0.000    0.000
LGA    L   210_A      L   210_A    39.126     0    0.034   0.180    41.830    0.000    0.000
LGA    Q   211_A      Q   211_A    33.392     0    0.020   0.701    38.698    0.000    0.000
LGA    A   212_A      A   212_A    26.284     0    0.013   0.014    28.857    0.000    0.000
LGA    E   213_A      E   213_A    25.560     0    0.037   0.430    33.337    0.000    0.000
LGA    D   214_A      D   214_A    29.188     0    0.015   1.078    34.751    0.000    0.000
LGA    E   215_A      E   215_A    23.654     0    0.066   1.002    25.325    0.000    0.000
LGA    A   216_A      A   216_A    21.998     0    0.072   0.112    23.782    0.000    0.000
LGA    D   217_A      D   217_A    22.503     0    0.029   0.858    25.348    0.000    0.000
LGA    Y   218_A      Y   218_A    29.253     0    0.041   1.231    31.932    0.000    0.000
LGA    Y   219_A      Y   219_A    31.008     0    0.024   0.162    35.048    0.000    0.000
LGA    C   220_A      C   220_A    37.283     0    0.012   0.119    38.753    0.000    0.000
LGA    C   221_A      C   221_A    39.224     0    0.093   0.581    43.703    0.000    0.000
LGA    S   222_A      S   222_A    44.788     0    0.057   0.071    47.729    0.000    0.000
LGA    Y   223_A      Y   223_A    48.765     0    0.034   1.395    56.919    0.000    0.000
LGA    A   224_A      A   224_A    49.029     0    0.479   0.478    51.829    0.000    0.000
LGA    G   225_A      G   225_A    56.104     0    0.656   0.656    56.473    0.000    0.000
LGA    D   226_A      D   226_A    56.514     0    0.565   1.315    57.223    0.000    0.000
LGA    Y   227_A      Y   227_A    53.685     0    0.186   1.261    65.850    0.000    0.000
LGA    T   228_A      T   228_A    46.435     0    0.384   1.197    49.316    0.000    0.000
LGA    P   229_A      P   229_A    44.553     0    0.054   0.088    44.793    0.000    0.000
LGA    G   230_A      G   230_A    44.202     0    0.470   0.470    45.064    0.000    0.000
LGA    V   231_A      V   231_A    40.783     0    0.141   1.132    41.429    0.000    0.000
LGA    V   232_A      V   232_A    35.965     0    0.041   0.084    39.289    0.000    0.000
LGA    F   233_A      F   233_A    32.257     0    0.035   0.163    34.192    0.000    0.000
LGA    G   234_A      G   234_A    30.806     0    0.080   0.080    31.635    0.000    0.000
LGA    G   235_A      G   235_A    24.873     0    0.047   0.047    27.349    0.000    0.000
LGA    G   236_A      G   236_A    25.547     0    0.021   0.021    26.158    0.000    0.000
LGA    T   237_A      T   237_A    27.814     0    0.022   0.050    32.068    0.000    0.000
LGA    K   238_A      K   238_A    24.184     0    0.053   1.078    27.732    0.000    0.000
LGA    L   239_A      L   239_A    27.992     0    0.038   0.900    33.702    0.000    0.000
LGA    T   240_A      T   240_A    26.679     0    0.024   0.255    30.895    0.000    0.000
LGA    V   241_A      V   241_A    29.099     0    0.063   0.090    30.028    0.000    0.000
LGA    L   242_A      L   242_A    31.496     0    0.057   1.061    34.028    0.000    0.000
LGA    G   243_A      G   243_A    30.052     0    0.397   0.397    31.994    0.000    0.000

# RMSD_GDC results:       CA      MC common percent     ALL common percent   GDC_mc  GDC_all
NUMBER_OF_ATOMS_AA:      240     960    960  100.00    1805   1805  100.00               240
SUMMARY(RMSD_GDC):    16.090         16.041                 16.587           44.768   42.245

#CA            N1   N2   DIST      N    RMSD    GDT_TS    LGA_S3     LGA_Q 
SUMMARY(GDT)  256  240    4.0    121    1.23    47.396    49.032     9.098

LGA_LOCAL      RMSD:   1.230  Number of atoms:  121  under DIST:   4.00
LGA_ASGN_ATOMS RMSD:  29.627  Number of assigned atoms:  240 
Std_ASGN_ATOMS RMSD:  16.090  Standard rmsd on all 240 assigned CA atoms 

Unitary ROTATION matrix and the SHIFT vector superimpose molecules  (1=>2)
  X_new =   0.410264 * X  +  -0.631159 * Y  +   0.658272 * Z  +  44.383278
  Y_new =   0.342328 * X  +   0.775614 * Y  +   0.530315 * Z  + -62.411022
  Z_new =  -0.845278 * X  +   0.007776 * Y  +   0.534270 * Z  +  63.597145 

Euler angles from the ROTATION matrix. Conventions XYZ and ZXZ:
           Phi     Theta       Psi   [DEG:       Phi     Theta       Psi ]
XYZ:  0.695373  1.007086  0.014553   [DEG:   39.8419   57.7017    0.8338 ]
ZXZ:  2.248953  1.007152 -1.561597   [DEG:  128.8555   57.7056  -89.4729 ]
 
# END of job
